4-[1-[8-(2-imidazol-1-ylphenyl)-5,5-dimethyl-6H-naphthalen-2-yl]ethenyl]benzoic acid

Systemtic Name: 4-[1-[8-(2-imidazol-1-ylphenyl)-5,5-dimethyl-6H-naphthalen-2-yl]ethenyl]benzoic acid Openeye Name: 4-[1-[8-(2-imidazol-1-ylphenyl)-5,5-dimethyl-6H-naphthalen-2-yl]vinyl]benzoic acid CAS Name: 4-[1-[8-[2-(1-imidazolyl)phenyl]-5,5-dimethyl-6H-naphthalen-2-yl]ethenyl]benzoic acid IUPAC Name: 4-[1-[8-(2-imidazol-1-ylphenyl)-5,5-dimethyl-6H-naphthalen-2-yl]ethenyl]benzoic acid Traditional Name: 4-[1-[8-(2-imidazol-1-ylphenyl)-5,5-dimethyl-6H-naphthalen-2-yl]vinyl]benzoic acid Formula: C30H26N2O2 MolecularWeight: 446.53964

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC=C(C2=C1C=CC(=C2)C(=C)C3=CC=C(C=C3)C(=O)O)C4=CC=CC=C4N5C=CN=C5)C

Isomeric SMILES

CC1(CC=C(C2=C1C=CC(=C2)C(=C)C3=CC=C(C=C3)C(=O)O)C4=CC=CC=C4N5C=CN=C5)C

InChI

InChI=1S/C30H26N2O2/c1-20(21-8-10-22(11-9-21)29(33)34)23-12-13-27-26(18-23)24(14-15-30(27,2)3)25-6-4-5-7-28(25)32-17-16-31-19-32/h4-14,16-19H,1,15H2,2-3H3,(H,33,34)